SCHEMBL3607906

SCHEMBL3607906

O=C(O)NC1CCN(CC2CCc3c(F)ccc4ccc(=O)n2c34)CC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.38
SIGMAR1 Q99720 6/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
MCHR1 Q99705 4/20 0.35
CCR3 P51677 2/20 0.34
KMT2A Q03164 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2819511 0.91 SIGMAR1 (0.36) CHRM1SIGMAR1L3MBTL1MCHR1CCR3
SCHEMBL3602537 0.83 SIGMAR1 (0.35) SIGMAR1L3MBTL1MCHR1CCR3KMT2A
SCHEMBL3607054 0.83 KDM1A (0.32)
SCHEMBL3604795 0.76 CDK4 (0.37)
SCHEMBL3730946 0.75 CCR1 (0.35) CHRM1SIGMAR1L3MBTL1MCHR1KMT2A
SCHEMBL922023 0.74 SIGMAR1 (0.40) CHRM1SIGMAR1L3MBTL1MCHR1CCR3
SCHEMBL3155543 0.74 SLC2A1 (0.54) SIGMAR1L3MBTL1MCHR1
SCHEMBL3616104 0.74 KCNH2 (0.57)
SCHEMBL3323992 0.73 TOP2A (0.40) CHRM1SIGMAR1L3MBTL1MCHR1KMT2A
SCHEMBL3328189 0.73 TOP2A (0.40) CHRM1SIGMAR1L3MBTL1MCHR1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100087424-A1 TRICYCLIC NITROGEN CONTAINING HETEROCYCLES AS ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED 2010-04-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100087424-A1 TRICYCLIC NITROGEN CONTAINING HETEROCYCLES AS ANTIBACTERIAL AGENTS NRDC, NDC1, NANS CHRM1 4316/4885SIGMAR1 211/4885L3MBTL1 2051/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.